O1-methyl O3-(2-nitro-4-phenylmethoxy-phenyl) 2-methylpropanedioate

Systemtic Name: O1-methyl O3-(2-nitro-4-phenylmethoxy-phenyl) 2-methylpropanedioate Openeye Name: O1-(4-benzyloxy-2-nitro-phenyl) O3-methyl 2-methylpropanedioate CAS Name: 2-methylpropanedioic acid O1-methyl ester O3-(2-nitro-4-phenylmethoxyphenyl) ester IUPAC Name: 1-O-methyl 3-O-(2-nitro-4-phenylmethoxyphenyl) 2-methylpropanedioate Traditional Name: 2-methylmalonic acid O1-(4-benzoxy-2-nitro-phenyl) ester O3-methyl ester Formula: C18H17NO7 MolecularWeight: 359.33008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)C(=O)OC1=C(C=C(C=C1)OCC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)OC)C(=O)OC1=C(C=C(C=C1)OCC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H17NO7/c1-12(17(20)24-2)18(21)26-16-9-8-14(10-15(16)19(22)23)25-11-13-6-4-3-5-7-13/h3-10,12H,11H2,1-2H3